SCHEMBL31075478

SCHEMBL31075478

CC(F)(F)CC[C@@H](N)CNC1CCCC1

nearest known ligand 0.39

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 2/20 0.39
ERAP2 Q6P179 2/20 0.39
KDM4E B2RXH2 1/20 0.39
HTT P42858 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL31075343 0.84
SCHEMBL31075606 0.76
SCHEMBL11437981 0.75 KDM4E (0.48) ANPEPERAP2KDM4EHTTSMN1; SMN2
SCHEMBL3585774 0.73 KDM4E (0.50) ANPEPERAP2KDM4EHTTSMN1; SMN2
SCHEMBL9810147 0.73 KDM4E (0.50) ANPEPERAP2KDM4EHTTSMN1; SMN2
SCHEMBL31390192 0.72
SCHEMBL28080703 0.71 KDM4E (0.52) ANPEPERAP2KDM4EHTTSMN1; SMN2
SCHEMBL29100048 0.70 KDM4E (0.50) ANPEPERAP2KDM4EHTTSMN1; SMN2
SCHEMBL30411672 0.69 KDM4E (0.50) ANPEPERAP2KDM4EHTTSMN1; SMN2
SCHEMBL2801217 0.69 KDM4E (0.54) ANPEPERAP2KDM4EHTTSMN1; SMN2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025043094-A1 BENZOTHIA(DIA)ZEPINE COMPOUNDS FOR TREATMENT OF HBV AND HDV ASSEMBLY BIOSCIENCES, INC. (US) 2025-02-27 WO disclosed
WO-2024177984-A1 BENZOTHIA(DIA)ZEPINE COMPOUNDS FOR TREATMENT OF HBV AND HDV ASSEMBLY BIOSCIENCES, INC. (US) 2024-08-29 WO disclosed